N-[3-(2-ethylpiperidin-1-yl)propyl]-2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamide
Chemical Structure Depiction of
N-[3-(2-ethylpiperidin-1-yl)propyl]-2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamide
N-[3-(2-ethylpiperidin-1-yl)propyl]-2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamide
Compound characteristics
| Compound ID: | E019-0798 |
| Compound Name: | N-[3-(2-ethylpiperidin-1-yl)propyl]-2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamide |
| Molecular Weight: | 454.63 |
| Molecular Formula: | C25 H34 N4 O2 S |
| Smiles: | CCC1CCCCN1CCCNC(C(CC)N1C(c2c3ccccc3sc2C(C)=N1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5971 |
| logD: | 1.6721 |
| logSw: | -4.2325 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.825 |
| InChI Key: | ZGYBONLZZLLUEJ-UHFFFAOYSA-N |